Cas no 833447-39-5 (2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)-)
833447-39-5 structure
Product Name:2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)-
CAS No:833447-39-5
MF:C12H14N2O6
MW:282.249363422394
CID:673404
PubChem ID:71415640
Update Time:2025-04-19
2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)-
- bis(2-methoxyethyl) 2,3-dicyanobut-2-enedioate
- 833447-39-5
- DTXSID00835051
-
- Inchi： 1S/C12H14N2O6/c1-17-3-5-19-11(15)9(7-13)10(8-14)12(16)20-6-4-18-2/h3-6H2,1-2H3
- InChI Key： KASHDYHSSZTBMP-UHFFFAOYSA-N
- SMILES： O(C(C(C#N)=C(C#N)C(=O)OCCOC)=O)CCOC
Computed Properties
- Exact Mass: 282.08518617g/mol
- Monoisotopic Mass: 282.08518617g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 20
- Rotatable Bond Count: 10
- Complexity: 435
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: -0.2
- Topological Polar Surface Area: 119?2
2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
833447-39-5 (2-Butenedioic acid, 2,3-dicyano-, bis(2-methoxyethyl) ester, (2E)-) Related Products
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